1,3-bis[(3-ethyloxetan-3-yl)methoxy]propan-2-ol

C15H28O5 — CID 57493389

IUPAC1,3-bis[(3-ethyloxetan-3-yl)methoxy]propan-2-ol
SMILESCCC1(COCC(O)COCC2(CC)COC2)COC1
InChIInChI=1S/C15H28O5/c1-3-14(9-19-10-14)7-17-5-13(16)6-18-8-15(4-2)11-20-12-15/h13,16H,3-12H2,1-2H3
InChIKeyZVWRHIXJKNJPKB-UHFFFAOYSA-N
MW288.38 g/mol
LogP1.23
Rot. Bonds10

About 1,3-bis[(3-ethyloxetan-3-yl)methoxy]propan-2-ol

1,3-bis[(3-ethyloxetan-3-yl)methoxy]propan-2-ol (PubChem CID 57493389) has the molecular formula C15H28O5 and a molecular weight of 288.38 g/mol. Its IUPAC name is 1,3-bis[(3-ethyloxetan-3-yl)methoxy]propan-2-ol.

Molecular Properties

Compound Name1,3-bis[(3-ethyloxetan-3-yl)methoxy]propan-2-ol
PubChem CID57493389
Molecular FormulaC15H28O5
Molecular Weight288.38 g/mol
Exact Mass288.19
IUPAC Name1,3-bis[(3-ethyloxetan-3-yl)methoxy]propan-2-ol
SMILESCCC1(COCC(O)COCC2(CC)COC2)COC1
InChIInChI=1S/C15H28O5/c1-3-14(9-19-10-14)7-17-5-13(16)6-18-8-15(4-2)11-20-12-15/h13,16H,3-12H2,1-2H3
InChIKeyZVWRHIXJKNJPKB-UHFFFAOYSA-N
XLogP1.23
TPSA57.15 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds10
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.38
LogP ≤ 51.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 1,3-bis[(3-ethyloxetan-3-yl)methoxy]propan-2-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1,3-bis[(3-ethyloxetan-3-yl)methoxy]propan-2-ol?
The IUPAC name of 1,3-bis[(3-ethyloxetan-3-yl)methoxy]propan-2-ol (CID 57493389) is 1,3-bis[(3-ethyloxetan-3-yl)methoxy]propan-2-ol.
What is the SMILES notation for 1,3-bis[(3-ethyloxetan-3-yl)methoxy]propan-2-ol?
The canonical SMILES for 1,3-bis[(3-ethyloxetan-3-yl)methoxy]propan-2-ol is CCC1(COCC(O)COCC2(CC)COC2)COC1.
What is the InChIKey of 1,3-bis[(3-ethyloxetan-3-yl)methoxy]propan-2-ol?
The InChIKey is ZVWRHIXJKNJPKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28O5/c1-3-14(9-19-10-14)7-17-5-13(16)6-18-8-15(4-2)11-20-12-15/h13,16H,3-12H2,1-2H3.
What are the key properties of 1,3-bis[(3-ethyloxetan-3-yl)methoxy]propan-2-ol?
1,3-bis[(3-ethyloxetan-3-yl)methoxy]propan-2-ol has a molecular weight of 288.38 g/mol, XLogP of 1.23, 10 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3-bis[(3-ethyloxetan-3-yl)methoxy]propan-2-ol is sourced from PubChem (CID 57493389), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).